4-[(4-chloranyl-2-nitro-phenoxy)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(4-chloranyl-2-nitro-phenoxy)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(4-chloro-2-nitro-phenoxy)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(4-chloro-2-nitrophenoxy)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(4-chloro-2-nitrophenoxy)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(4-chloro-2-nitro-phenoxy)methyl]thiazole-2-carboxylic acid Formula: C11H7ClN2O5S MolecularWeight: 314.70168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])OCC2=CSC(=N2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])OCC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C11H7ClN2O5S/c12-6-1-2-9(8(3-6)14(17)18)19-4-7-5-20-10(13-7)11(15)16/h1-3,5H,4H2,(H,15,16)